Methyl 2,3-dinitrobenzoate

CAS Registry Number®

42087-83-2
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CAS Name

Methyl 2,3-dinitrobenzoate

Molecular Formula

C8H6N2O6

Molecular Mass

226.14

Cite this Page

Methyl 2,3-dinitrobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42087-83-2 (retrieved 2024-08-05) (CAS RN: 42087-83-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    134 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6N2O6/c1-16-8(11)5-3-2-4-6(9(12)13)7(5)10(14)15/h2-4H,1H3

InChIKey

InChIKey=CVECQSXVBHHMBT-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=C(C(OC)=O)C=CC=C1N(=O)=O

Canonical SMILES

O=C(OC)C1=CC=CC(=C1N(=O)=O)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 2,3-dinitro-, methyl ester
  • Methyl 2,3-dinitrobenzoate
  • 2,3-Dinitrobenzoic acid methyl ester